SCHEMBL3134409

SCHEMBL3134409

N[C@@H](CCc1ccccc1)C1OCCO1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.42
ERAP1 Q9NZ08 2/20 0.42
ERAP2 Q6P179 1/20 0.42
DRD4 P21917 2/20 0.39
CYP2C19 P33261 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38
CYP2A6 P11509 1/20 0.38
HTR2A P28223 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
EPHX1 P07099 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3123916 0.81 EPHX1 (0.48) ANPEPTAAR1CYP2A6SLC6A2SLC6A4
SCHEMBL3129213 0.81 EPHX1 (0.48) ANPEPTAAR1CYP2A6SLC6A2SLC6A4
SCHEMBL1818191 0.80 ANPEP (0.43) ANPEPERAP1ERAP2TAAR1CYP2A6
SCHEMBL4608897 0.80 ANPEP (0.43) ANPEPERAP1ERAP2TAAR1CYP2A6
SCHEMBL17604782 0.76 ANPEP (0.46) ANPEPERAP1ERAP2TAAR1CYP2A6
SCHEMBL3133675 0.75 TACR1 (0.49) TAAR1
Hydrochloric Acid SCHEMBL7303614 0.74 ANPEP (0.44) ANPEPERAP1ERAP2TAAR1CYP2A6
SCHEMBL6551164 0.73 SLC18A2 (0.46) ANPEPERAP1ERAP2
SCHEMBL7785415 0.73 SLC18A2 (0.46) ANPEPERAP1ERAP2
SCHEMBL9390743 0.73 ALDH1A1 (0.44) ANPEPERAP1ERAP2TAAR1SLC6A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1491537-B1 HYDROXYMORPHOLINONE DERIVATIVE AND MEDICINAL USE THEREOF SENJU PHARMA CO (JP) 2010-07-07 EP disclosed
US-7223755-B2 Hydroxymorpholinone derivative and medicinal use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2007-05-29 US disclosed
US-20050176704-A1 Hydroxymorpholinone derivative and medicinal use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2005-08-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050176704-A1 Hydroxymorpholinone derivative and medicinal use thereof CAPN1, OPRM1, CAPN2 ANPEP 974/4885ERAP1 291/4885ERAP2 517/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.